2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine

C37H27N — CID 150843881

IUPAC2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine
SMILESCc1c2c(c(-c3cccc(-c4ccccn4)c3)c(-c3ccccc3)c1-c1ccccc1)Cc1ccccc1-2
InChIInChI=1S/C37H27N/c1-25-34(26-13-4-2-5-14-26)37(27-15-6-3-7-16-27)36(32-24-28-17-8-9-20-31(28)35(25)32)30-19-12-18-29(23-30)33-21-10-11-22-38-33/h2-23H,24H2,1H3
InChIKeyKOOSEVBZHLMSLA-UHFFFAOYSA-N
MW485.63 g/mol
LogP9.63
Rot. Bonds4

About 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine

2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine (PubChem CID 150843881) has the molecular formula C37H27N and a molecular weight of 485.63 g/mol. Its IUPAC name is 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine.

Molecular Properties

Compound Name2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine
PubChem CID150843881
Molecular FormulaC37H27N
Molecular Weight485.63 g/mol
Exact Mass485.21
IUPAC Name2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine
SMILESCc1c2c(c(-c3cccc(-c4ccccn4)c3)c(-c3ccccc3)c1-c1ccccc1)Cc1ccccc1-2
InChIInChI=1S/C37H27N/c1-25-34(26-13-4-2-5-14-26)37(27-15-6-3-7-16-27)36(32-24-28-17-8-9-20-31(28)35(25)32)30-19-12-18-29(23-30)33-21-10-11-22-38-33/h2-23H,24H2,1H3
InChIKeyKOOSEVBZHLMSLA-UHFFFAOYSA-N
XLogP9.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms38
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.63
LogP ≤ 59.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine?
The IUPAC name of 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine (CID 150843881) is 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine.
What is the SMILES notation for 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine?
The canonical SMILES for 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine is Cc1c2c(c(-c3cccc(-c4ccccn4)c3)c(-c3ccccc3)c1-c1ccccc1)Cc1ccccc1-2.
What is the InChIKey of 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine?
The InChIKey is KOOSEVBZHLMSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H27N/c1-25-34(26-13-4-2-5-14-26)37(27-15-6-3-7-16-27)36(32-24-28-17-8-9-20-31(28)35(25)32)30-19-12-18-29(23-30)33-21-10-11-22-38-33/h2-23H,24H2,1H3.
What are the key properties of 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine?
2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine has a molecular weight of 485.63 g/mol, XLogP of 9.63, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-methyl-2,3-diphenyl-9H-fluoren-1-yl)phenyl]pyridine is sourced from PubChem (CID 150843881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).